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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL355014
CHEMBL355014
Compound Name FLUORANTHENE
ChEMBL Synonyms Fluoranthene
Max Phase 0
Trade Names
Molecular Formula C16H10

Additional synonyms for CHEMBL355014 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES c1ccc2c(c1)c3cccc4cccc2c34
Standard InChI InChI=1S/C16H10/c1-2-8-13-12(7-1)14-9-3-5-11-6-4-10-15(13)16 ...
Download InChI
Standard InChI Key GVEPBJHOBDJJJI-UHFFFAOYSA-N

Structural Alerts

There are 1 structural alerts for CHEMBL355014. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL355014

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
202.3 202.0783 3.95 0 0 -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
0 0 0 0 0 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - 5 5 3 16 0.52

Compound Cross References

ChemSpider ChemSpider:GVEPBJHOBDJJJI-UHFFFAOYSA-N
PubChem SID: 144209033 SID: 144210798 SID: 17389001 SID: 26752867 SID: 56463678
Wikipedia Fluoranthene

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL355014



ACToR 206-44-0 76774-50-0
ChEBI 33083
eMolecules 501817
EPA CompTox Dashboard DTXSID3024104
FDA SRS 360UOL779Z
IBM Patent System 42FC60A5EEE0D50E4845971CCF4E4F76
KEGG Ligand C19425
Mcule MCULE-8741992230
MolPort MolPort-001-787-035
Nikkaji J2.973D
NMRShiftDB 10016521
PubChem 9154
PubChem: Thomson Pharma 14818719
SureChEMBL SCHEMBL27152
ZINC ZINC08585874

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/GVEPBJHOBDJJJI-UHFFFAOYSA-N spacer
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